ChemSpider 2D Image | Bis(3-phenylpropyl) 4,4'-[oxybis(4,1-phenyleneimino)]bis(4-oxobutanoate) | C38H40N2O7

Bis(3-phenylpropyl) 4,4'-[oxybis(4,1-phenyleneimino)]bis(4-oxobutanoate)

  • Molecular FormulaC38H40N2O7
  • Average mass636.733 Da
  • Monoisotopic mass636.283569 Da
  • ChemSpider ID4116754

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4,4'-[Oxybis(4,1-phénylèneimino)]bis(4-oxobutanoate) de bis(3-phénylpropyle) [French] [ACD/IUPAC Name]
Bis(3-phenylpropyl) 4,4'-[oxybis(4,1-phenyleneimino)]bis(4-oxobutanoate) [ACD/IUPAC Name]
Bis(3-phenylpropyl)-4,4'-[oxybis(4,1-phenylenimino)]bis(4-oxobutanoat) [German] [ACD/IUPAC Name]
Butanoic acid, 4,4'-[oxybis(4,1-phenyleneimino)]bis[4-oxo-, bis(3-phenylpropyl) ester [ACD/Index Name]
3-PHENYLPROPYL 3-[(4-{4-[4-OXO-4-(3-PHENYLPROPOXY)BUTANAMIDO]PHENOXY}PHENYL)CARBAMOYL]PROPANOATE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 842.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 122.4±3.0 kJ/mol
Flash Point: 463.1±34.3 °C
Index of Refraction: 1.610
Molar Refractivity: 180.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 2
ACD/LogP: 7.99
ACD/LogD (pH 5.5): 6.54
ACD/BCF (pH 5.5): 55183.39
ACD/KOC (pH 5.5): 86250.56
ACD/LogD (pH 7.4): 6.54
ACD/BCF (pH 7.4): 55186.00
ACD/KOC (pH 7.4): 86254.63
Polar Surface Area: 120 Å2
Polarizability: 71.4±0.5 10-24cm3
Surface Tension: 52.3±3.0 dyne/cm
Molar Volume: 519.6±3.0 cm3

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